2-[5-ethyl-6-methyl-4-oxidanylidene-3-(oxolan-2-ylmethyl)thieno[2,3-d]pyrimidin-2-yl]sulfanyl-N-(3-methylsulfanylphenyl)ethanamide

Systemtic Name: 2-[5-ethyl-6-methyl-4-oxidanylidene-3-(oxolan-2-ylmethyl)thieno[2,3-d]pyrimidin-2-yl]sulfanyl-N-(3-methylsulfanylphenyl)ethanamide Openeye Name: 2-[5-ethyl-6-methyl-4-oxo-3-(tetrahydrofuran-2-ylmethyl)thieno[2,3-d]pyrimidin-2-yl]sulfanyl-N-(3-methylsulfanylphenyl)acetamide CAS Name: 2-[[5-ethyl-6-methyl-4-oxo-3-(2-oxolanylmethyl)-2-thieno[2,3-d]pyrimidinyl]thio]-N-[3-(methylthio)phenyl]acetamide IUPAC Name: 2-[5-ethyl-6-methyl-4-oxo-3-(oxolan-2-ylmethyl)thieno[2,3-d]pyrimidin-2-yl]sulfanyl-N-(3-methylsulfanylphenyl)acetamide Traditional Name: 2-[[5-ethyl-4-keto-6-methyl-3-(tetrahydrofurfuryl)thieno[2,3-d]pyrimidin-2-yl]thio]-N-[3-(methylthio)phenyl]acetamide Formula: C23H27N3O3S3 MolecularWeight: 489.67378

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC2=C1C(=O)N(C(=N2)SCC(=O)NC3=CC(=CC=C3)SC)CC4CCCO4)C

Isomeric SMILES

CCC1=C(SC2=C1C(=O)N(C(=N2)SCC(=O)NC3=CC(=CC=C3)SC)CC4CCCO4)C

InChI

InChI=1S/C23H27N3O3S3/c1-4-18-14(2)32-21-20(18)22(28)26(12-16-8-6-10-29-16)23(25-21)31-13-19(27)24-15-7-5-9-17(11-15)30-3/h5,7,9,11,16H,4,6,8,10,12-13H2,1-3H3,(H,24,27)